SCHEMBL23116266

SCHEMBL23116266

CCCCCCCCCCCCSC(=S)SC(C)(CCCCC)C(=O)O

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GMNN O75496 1/20 0.38
TP53 P04637 1/20 0.38
POLB P06746 1/20 0.38
MAPT P10636 1/20 0.38
THRB P10828 1/20 0.38
CYP2C9 P11712 1/20 0.38
BLM P54132 1/20 0.38
HSD17B10 Q99714 1/20 0.38
FAAH O00519 4/20 0.34
CES1 P23141 4/20 0.34
CES2 O00748 4/20 0.34
PLA2G6 O60733 1/20 0.34
ACHE P22303 2/20 0.33
SMPD1 P17405 1/20 0.32
EPHX1 P07099 1/20 0.32
GGPS1 O95749 1/20 0.32
ALDH1A1 P00352 1/20 0.32
TSHR P16473 1/20 0.32
SLC22A6 Q4U2R8 1/20 0.32
SLC22A8 Q8TCC7 1/20 0.32

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL14895467 0.89 HSD17B10 (0.39) GMNNTP53POLBMAPTTHRB
SCHEMBL17556645 0.85 HSD17B10 (0.35) GMNNPOLBMAPTCYP2C9BLM
SCHEMBL988084 0.83 HSD17B10 (0.41) GMNNTP53POLBMAPTTHRB
SCHEMBL28441944 0.82 GMNN (0.33) GMNNTP53POLBMAPTTHRB
SCHEMBL25245173 0.82 GMNN (0.33) GMNNTP53POLBMAPTTHRB
SCHEMBL28388688 0.82 GMNN (0.36) GMNNTP53POLBMAPTTHRB
Hydrochloric Acid SCHEMBL1249049 0.81 HSD17B10 (0.40) GMNNTP53POLBMAPTTHRB
SCHEMBL22092414 0.81 HSD17B10 (0.42) GMNNTP53POLBMAPTTHRB
Ethylene SCHEMBL31337284 0.80 HSD17B10 (0.39) GMNNTP53POLBMAPTTHRB
Methoxymethane SCHEMBL30701424 0.79 HSD17B10 (0.38) GMNNTP53POLBMAPTTHRB

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210087320-A1 Styrene Maleamide Block Copolymer Pigment Dispersant THE UNIVERSITY OF WARWICK (GB) 2021-03-25 US disclosed